Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate
TL;DR: Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate (CAS 350989-50-3) is a chemical compound with molecular formula C14H22N2O3S and molecular weight 298.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-amino-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Also Known As: isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate, propan-2-yl 2-amino-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate, isopropyl 2-amino-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate, isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methyl-3-thiophenecarboxylate, Isopropyl 2-amino-5-(diethylamino)carbonyl-4-methylthiophene-3-carboxylate
| Molecular Formula | C14H22N2O3S |
|---|---|
| Molecular Weight | 298.14 g/mol |
| LogP | 2.68592 |
| Topological Polar Surface Area | 72.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.1351 |
| Heavy Atoms | 20 |
| Complexity | 504.76245 |
Chemical Identifiers
| CAS Number | 350989-50-3 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)N)C(=O)OC(C)C)C |
Product Overview
Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate (CAS 350989-50-3), with molecular formula C14H22N2O3S and molecular weight 298.14 g/mol. IUPAC: propan-2-yl 2-amino-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate.
Chemical Property Profile of Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate
Property Insights of Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate
The XLogP value of 2.68592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate. The TPSA of 72.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate?
The CAS number of Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate is 350989-50-3.
What is the molecular formula of Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate?
The molecular formula of Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate is C14H22N2O3S.
What is the molecular weight of Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate?
The molecular weight of Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate is 298.14 g/mol.
Where can I buy Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate?
You can request a quote for Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.